[3-(naphthalen-2-ylamino)-3-oxopropyl]azanium

C13H15N2O+ — CID 7021427

IUPAC[3-(naphthalen-2-ylamino)-3-oxopropyl]azanium
SMILES[NH3+]CCC(=O)Nc1ccc2ccccc2c1
InChIInChI=1S/C13H14N2O/c14-8-7-13(16)15-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9H,7-8,14H2,(H,15,16)/p+1
InChIKeyFNMOUVSMWUISMV-UHFFFAOYSA-O
MW215.28 g/mol
LogP1.41
Rot. Bonds3

About [3-(naphthalen-2-ylamino)-3-oxopropyl]azanium

[3-(naphthalen-2-ylamino)-3-oxopropyl]azanium (PubChem CID 7021427) has the molecular formula C13H15N2O+ and a molecular weight of 215.28 g/mol. Its IUPAC name is [3-(naphthalen-2-ylamino)-3-oxopropyl]azanium.

Molecular Properties

Compound Name[3-(naphthalen-2-ylamino)-3-oxopropyl]azanium
PubChem CID7021427
Molecular FormulaC13H15N2O+
Molecular Weight215.28 g/mol
Exact Mass215.12
IUPAC Name[3-(naphthalen-2-ylamino)-3-oxopropyl]azanium
SMILES[NH3+]CCC(=O)Nc1ccc2ccccc2c1
InChIInChI=1S/C13H14N2O/c14-8-7-13(16)15-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9H,7-8,14H2,(H,15,16)/p+1
InChIKeyFNMOUVSMWUISMV-UHFFFAOYSA-O
XLogP1.41
TPSA56.74 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.28
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-naphthalen-2-yl-8-oxononanamide
CID 156626701
3-(ethylamino)-N-naphthalen-2-ylpropanamide
CID 62833227
N-naphthalen-2-yl-2-[2-[2-(naphthalen-2-ylamino)-2-oxoethoxy]phenoxy]acetamide
CID 10528581
2-(dimethylamino)-N-naphthalen-2-ylacetamide
CID 54844205
N-naphthalen-2-yl-2-naphthalen-2-yloxyacetamide
CID 879369
N-naphthalen-2-yl-2-[3-[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfanylpropylsulfanyl]acetamide
CID 4994531
2-(diethylamino)-N-naphthalen-2-ylacetamide
CID 44883479
3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide
CID 100605346
4-[4-[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfanylanilino]-4-oxobutanoic acid
CID 22786345
N-naphthalen-2-ylcarbamoyl bromide
CID 115193346
3-(4-chlorophenyl)sulfonyl-N-naphthalen-2-ylpropanamide
CID 2902895
phenacyl 4-(naphthalen-2-ylamino)-4-oxobutanoate
CID 2268864

Frequently Asked Questions

What is the IUPAC name of [3-(naphthalen-2-ylamino)-3-oxopropyl]azanium?
The IUPAC name of [3-(naphthalen-2-ylamino)-3-oxopropyl]azanium (CID 7021427) is [3-(naphthalen-2-ylamino)-3-oxopropyl]azanium.
What is the SMILES notation for [3-(naphthalen-2-ylamino)-3-oxopropyl]azanium?
The canonical SMILES for [3-(naphthalen-2-ylamino)-3-oxopropyl]azanium is [NH3+]CCC(=O)Nc1ccc2ccccc2c1.
What is the InChIKey of [3-(naphthalen-2-ylamino)-3-oxopropyl]azanium?
The InChIKey is FNMOUVSMWUISMV-UHFFFAOYSA-O. The full InChI is InChI=1S/C13H14N2O/c14-8-7-13(16)15-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9H,7-8,14H2,(H,15,16)/p+1.
What are the key properties of [3-(naphthalen-2-ylamino)-3-oxopropyl]azanium?
[3-(naphthalen-2-ylamino)-3-oxopropyl]azanium has a molecular weight of 215.28 g/mol, XLogP of 1.41, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(naphthalen-2-ylamino)-3-oxopropyl]azanium is sourced from PubChem (CID 7021427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).